(phenylmethyl) 3-oxidanyl-2,5-bis(2-oxidanylidene-4,5-diphenyl-1,3-oxazol-3-yl)pentanoate

Systemtic Name: (phenylmethyl) 3-oxidanyl-2,5-bis(2-oxidanylidene-4,5-diphenyl-1,3-oxazol-3-yl)pentanoate Openeye Name: benzyl 3-hydroxy-2,5-bis(2-oxo-4,5-diphenyl-oxazol-3-yl)pentanoate CAS Name: 3-hydroxy-2,5-bis(2-oxo-4,5-diphenyl-3-oxazolyl)pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-hydroxy-2,5-bis(2-oxo-4,5-diphenyl-1,3-oxazol-3-yl)pentanoate Traditional Name: 3-hydroxy-2,5-bis(2-keto-4,5-diphenyl-4-oxazolin-3-yl)valeric acid benzyl ester Formula: C42H34N2O7 MolecularWeight: 678.72856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(C(CCN2C(=C(OC2=O)C3=CC=CC=C3)C4=CC=CC=C4)O)N5C(=C(OC5=O)C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(C(CCN2C(=C(OC2=O)C3=CC=CC=C3)C4=CC=CC=C4)O)N5C(=C(OC5=O)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C42H34N2O7/c45-34(26-27-43-35(30-18-8-2-9-19-30)38(50-41(43)47)32-22-12-4-13-23-32)37(40(46)49-28-29-16-6-1-7-17-29)44-36(31-20-10-3-11-21-31)39(51-42(44)48)33-24-14-5-15-25-33/h1-25,34,37,45H,26-28H2